[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]amino]butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-[[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl]amino]butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfanyl-1-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]carbamoyl]propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-[[2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl]amino]butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]amino]butan-2-yl]azanium Traditional Name: [(1S)-1-[[2-keto-4-(trifluoromethyl)chromen-7-yl]carbamoyl]-3-(methylthio)propyl]ammonium Formula: C15H16F3N2O3S+ MolecularWeight: 361.35935

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F)[NH3+]

InChI

InChI=1S/C15H15F3N2O3S/c1-24-5-4-11(19)14(22)20-8-2-3-9-10(15(16,17)18)7-13(21)23-12(9)6-8/h2-3,6-7,11H,4-5,19H2,1H3,(H,20,22)/p+1/t11-/m0/s1